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Basis Sets in Computational Chemistry [2021]
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An Introduction and Overview of Basis Sets for Molecular and Solid-State Calculations
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Slater-Type Orbitals
- 3
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Local Orbitals in Quantum Chemistry
- 4
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An Introduction to Discretization Error Analysis for Computational Chemists
- 5
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Basis Sets for Correlated Methods
- 6
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Gaussian Basis Sets for Solid State Calculations
- 7
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Basis Sets for Heavy Atoms
- 8
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Adaptable Gaussian Bases for Quantum Dynamics of the Nuclei